N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide
TL;DR: N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide (CAS 867159-68-0) is a chemical compound with molecular formula C21H24ClN3O and molecular weight 369.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)but-2-enamide
Also Known As: 3-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)but-2-enamide, N-(4-CHLOROPHENYL)-3-(4-BENZYLPIPERAZINYL)BUT-2-ENAMIDE, C21H24ClN3O
| Molecular Formula | C21H24ClN3O |
|---|---|
| Molecular Weight | 369.16 g/mol |
| LogP | 4.0001 |
| Topological Polar Surface Area | 35.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 369.1608 |
| Heavy Atoms | 26 |
| Complexity | 750.58545 |
Chemical Identifiers
| CAS Number | 867159-68-0 |
|---|---|
| SMILES | CC(=CC(=O)NC1=CC=C(C=C1)Cl)N2CCN(CC2)CC3=CC=CC=C3 |
Product Overview
N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide (CAS 867159-68-0), with molecular formula C21H24ClN3O and molecular weight 369.16 g/mol. IUPAC: 3-(4-benzylpiperazin-1-yl)-N-(4-chlorophenyl)but-2-enamide.
Chemical Property Profile of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide
Property Insights of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide
The XLogP value of 4.0001 indicates that N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.58 Ų, N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide?
The CAS number of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide is 867159-68-0.
What is the molecular formula of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide?
The molecular formula of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide is C21H24ClN3O.
What is the molecular weight of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide?
The molecular weight of N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide is 369.16 g/mol.
Where can I buy N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide?
You can request a quote for N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Chlorophenyl)-3-(4-benzylpiperazinyl)but-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.